2-butylsulfanyl-3-(3-chlorophenyl)-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-butylsulfanyl-3-(3-chlorophenyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-butylsulfanyl-3-(3-chlorophenyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-(butylthio)-3-(3-chlorophenyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-butylsulfanyl-3-(3-chlorophenyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-(butylthio)-3-(3-chlorophenyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C20H18ClN3OS MolecularWeight: 383.89442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C(=O)N1C3=CC(=CC=C3)Cl)NC4=CC=CC=C42

Isomeric SMILES

CCCCSC1=NC2=C(C(=O)N1C3=CC(=CC=C3)Cl)NC4=CC=CC=C42

InChI

InChI=1S/C20H18ClN3OS/c1-2-3-11-26-20-23-17-15-9-4-5-10-16(15)22-18(17)19(25)24(20)14-8-6-7-13(21)12-14/h4-10,12,22H,2-3,11H2,1H3